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Chemical Entities of Biological Interest Ontology
Last uploaded:
November 5, 2024
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| Preferred Name | norelgestromin | |
| Synonyms |
17-Deacetylnorgestimate Levonorgestrel oxime BRN 4202099 progestin norelgestromin 18-Methylnorethindrone oxime |
|
| ID |
http://purl.obolibrary.org/obo/CHEBI_135398 |
|
| charge |
0
|
|
| database_cross_reference |
Drug_Central:1959 CAS:53016-31-2
|
|
| formula |
C21H29NO2
|
|
| has parent hydride | ||
| has_obo_namespace |
chebi_ontology
|
|
| has_related_synonym |
17-Deacetylnorgestimate Levonorgestrel oxime BRN 4202099 progestin norelgestromin 18-Methylnorethindrone oxime
|
|
| id |
CHEBI:135398
|
|
| in_subset | ||
| inchi |
InChI=1S/C21H29NO2/c1-3-20-11-9-17-16-8-6-15(22-24)13-14(16)5-7-18(17)19(20)10-12-21(20,23)4-2/h2,13,16-19,23-24H,3,5-12H2,1H3/t16-,17+,18+,19-,20-,21-/m0/s1
|
|
| inchikey |
ISHXLNHNDMZNMC-XUDSTZEESA-N
|
|
| label |
norelgestromin
|
|
| mass |
327.461
|
|
| monoisotopicmass |
327.21983
|
|
| notation |
CHEBI:135398
|
|
| prefLabel |
norelgestromin
|
|
| smiles |
C(C)[C@@]12[C@]([C@]3([C@](CC1)([C@@]4(C(CC3)=CC(CC4)=NO)[H])[H])[H])(CC[C@]2(C#C)O)[H]
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| treeView | ||
| subClassOf |
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